2-(3-cyclopentyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-(3-cyclopentyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide
2-(3-cyclopentyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | CM4207-2270 |
| Compound Name: | 2-(3-cyclopentyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide |
| Molecular Weight: | 402.58 |
| Molecular Formula: | C22 H38 N6 O |
| Smiles: | CCN1CCN(CCNC(CC2CCc3nnc(C4CCCC4)n3CC2)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3756 |
| logD: | 0.583 |
| logSw: | -1.3781 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.381 |
| InChI Key: | DMUFZTUWMSAURQ-SFHVURJKSA-N |